N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine

C12H19N5 — CID 70599618

IUPACN-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine
SMILESCCc1nc(CC)c(C)c(NC2=NCCN2)n1
InChIInChI=1S/C12H19N5/c1-4-9-8(3)11(16-10(5-2)15-9)17-12-13-6-7-14-12/h4-7H2,1-3H3,(H2,13,14,15,16,17)
InChIKeyDPYCNOPHTAWAIB-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.28
Rot. Bonds3

About N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine

N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine (PubChem CID 70599618) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine
PubChem CID70599618
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC NameN-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine
SMILESCCc1nc(CC)c(C)c(NC2=NCCN2)n1
InChIInChI=1S/C12H19N5/c1-4-9-8(3)11(16-10(5-2)15-9)17-12-13-6-7-14-12/h4-7H2,1-3H3,(H2,13,14,15,16,17)
InChIKeyDPYCNOPHTAWAIB-UHFFFAOYSA-N
XLogP1.28
TPSA62.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine (CID 70599618) is N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine is CCc1nc(CC)c(C)c(NC2=NCCN2)n1.
What is the InChIKey of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine?
The InChIKey is DPYCNOPHTAWAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-4-9-8(3)11(16-10(5-2)15-9)17-12-13-6-7-14-12/h4-7H2,1-3H3,(H2,13,14,15,16,17).
What are the key properties of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine?
N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine has a molecular weight of 233.32 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 70599618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).